SCHEMBL18907154

SCHEMBL18907154

[C-]#[N+]c1c(Oc2ccc3ccc(OCC#C)cc3c2)cccc1Oc1cc2c(cc1Oc1cccc(Oc3ccc4ccc(OCC#C)cc4c3)c1[N+]#[C-])C1(CC(C)(C)c3cc(Oc4cccc(Oc5ccc6ccc(OCC#C)cc6c5)c4C#N)c(Oc4cccc(Oc5ccc6ccc(OCC#C)cc6c5)c4C#N)cc31)CC2(C)C

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL18914629 0.93 MEN1 (0.34) MEN1NPC1RAB9AKMT2A
SCHEMBL18907155 0.92
SCHEMBL18179346 0.89 MEN1 (0.37) MEN1NPC1RAB9AKMT2A
SCHEMBL18914626 0.88 MEN1 (0.33) MEN1NPC1RAB9AKMT2A
SCHEMBL18914483 0.85 MAOA (0.33) MEN1KMT2A
SCHEMBL18907150 0.83 MAPT (0.32)
SCHEMBL18907151 0.83
SCHEMBL18907159 0.83
SCHEMBL18907152 0.82
SCHEMBL18907164 0.81 UGT2B7 (0.31)

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180114698-A2 COMPOSITION FOR FILM FORMATION, FILM, PRODUCTION METHOD OF PATTERNED SUBSTRATE, AND COMPOUND JSR CORPORATION (JP) 2018-04-26 US disclosed
US-20170154782-A1 COMPOSITION FOR FILM FORMATION, FILM, PRODUCTION METHOD OF PATTERNED SUBSTRATE, AND COMPOUND JSR CORPORATION (JP) 2017-06-01 US disclosed